N-[2-(azepan-1-yl)-2-oxidanylidene-ethyl]-3,5-dimethyl-N-(4-propan-2-ylphenyl)-1,2-oxazole-4-sulfonamide

Systemtic Name: N-[2-(azepan-1-yl)-2-oxidanylidene-ethyl]-3,5-dimethyl-N-(4-propan-2-ylphenyl)-1,2-oxazole-4-sulfonamide Openeye Name: N-[2-(azepan-1-yl)-2-oxo-ethyl]-N-(4-isopropylphenyl)-3,5-dimethyl-isoxazole-4-sulfonamide CAS Name: N-[2-(1-azepanyl)-2-oxoethyl]-3,5-dimethyl-N-(4-propan-2-ylphenyl)-4-isoxazolesulfonamide IUPAC Name: N-[2-(azepan-1-yl)-2-oxoethyl]-3,5-dimethyl-N-(4-propan-2-ylphenyl)-1,2-oxazole-4-sulfonamide Traditional Name: N-[2-(azepan-1-yl)-2-keto-ethyl]-3,5-dimethyl-N-p-cumenyl-isoxazole-4-sulfonamide Formula: C22H31N3O4S MolecularWeight: 433.56424

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=NO1)C)S(=O)(=O)N(CC(=O)N2CCCCCC2)C3=CC=C(C=C3)C(C)C

Isomeric SMILES

CC1=C(C(=NO1)C)S(=O)(=O)N(CC(=O)N2CCCCCC2)C3=CC=C(C=C3)C(C)C

InChI

InChI=1S/C22H31N3O4S/c1-16(2)19-9-11-20(12-10-19)25(15-21(26)24-13-7-5-6-8-14-24)30(27,28)22-17(3)23-29-18(22)4/h9-12,16H,5-8,13-15H2,1-4H3